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4883-67-4 | 2-Nitrocyclohexanone
CAS No: 4883-67-4 Catalog No: AG003HSL MDL No:MFCD00001627
Product Description
Catalog Number:
AG003HSL
Chemical Name:
2-Nitrocyclohexanone
CAS Number:
4883-67-4
MDL Number:
MFCD00001627
IUPAC Name:
2-nitrocyclohexan-1-one
InChI:
InChI=1S/C6H9NO3/c8-6-4-2-1-3-5(6)7(9)10/h5H,1-4H2
InChI Key:
SZNILIWUUKKNPE-UHFFFAOYSA-N
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.058g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.142g/mol
Monoisotopic Mass:
143.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Asymmetric Michael additions of α-nitrocyclohexanone to aryl nitroalkenes catalyzed by natural amino acid-derived bifunctional thioureas. | Organic letters 20120907 |
| Effect of ring size on the tautomerization and ionization reaction of cyclic 2-nitroalkanones: an experimental and theoretical study. | The Journal of organic chemistry 20120120 |
| The base-catalyzed keto-enol interconversion of 2-nitrocyclohexanone in ionic liquids. | The Journal of organic chemistry 20090904 |
| Solvent effects on the rate of the keto-enol interconversion of 2-nitrocyclohexanone. | Organic & biomolecular chemistry 20081121 |
| Ionization and tautomerization of 2-nitrocyclohexanone in aqueous solution. | The Journal of organic chemistry 20070525 |
| Determination of the polarities of some ionic liquids using 2-nitrocyclohexanone as the probe. | The Journal of organic chemistry 20050930 |
| Nitrite elimination and hydrolytic ring cleavage in 2,4,6-trinitrophenol (picric acid) degradation. | Applied and environmental microbiology 20040501 |
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